Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate
TL;DR: Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate (CAS 352339-40-3) is a chemical compound with molecular formula C27H36N2O6 and molecular weight 484.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 11-[(4-methyl-2-nitro-3-phenylmethoxybenzoyl)amino]undecanoate
Also Known As: methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate, methyl 11-[(4-methyl-2-nitro-3-phenylmethoxybenzoyl)amino]undecanoate
| Molecular Formula | C27H36N2O6 |
|---|---|
| Molecular Weight | 484.26 g/mol |
| LogP | 5.89592 |
| Topological Polar Surface Area | 107.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Exact Mass | 484.25732 |
| Heavy Atoms | 35 |
| Complexity | 961.64386 |
Chemical Identifiers
| CAS Number | 352339-40-3 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)C(=O)NCCCCCCCCCCC(=O)OC)[N+](=O)[O-])OCC2=CC=CC=C2 |
Product Overview
Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate (CAS 352339-40-3), with molecular formula C27H36N2O6 and molecular weight 484.26 g/mol. IUPAC: methyl 11-[(4-methyl-2-nitro-3-phenylmethoxybenzoyl)amino]undecanoate.
Chemical Property Profile of Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate
Property Insights of Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate
The XLogP value of 5.89592 indicates that Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate. Following Lipinski's Rule of Five, Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate?
The CAS number of Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate is 352339-40-3.
What is the molecular formula of Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate?
The molecular formula of Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate is C27H36N2O6.
What is the molecular weight of Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate?
The molecular weight of Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate is 484.26 g/mol.
Where can I buy Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate?
You can request a quote for Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 11-({3-(benzyloxy)-2-nitro-4-methylbenzoyl}amino)undecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.